(2-chloranylpyridin-3-yl)-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone

Systemtic Name: (2-chloranylpyridin-3-yl)-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone Openeye Name: (2-chloro-3-pyridyl)-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone CAS Name: (2-chloro-3-pyridinyl)-[4-[3-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]methanone IUPAC Name: (2-chloropyridin-3-yl)-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone Traditional Name: (2-chloro-3-pyridyl)-[4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazino]methanone Formula: C16H15ClF3N4O+ MolecularWeight: 371.76471

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)C(F)(F)F)C(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)C(F)(F)F)C(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C16H14ClF3N4O/c17-13-11(3-1-5-21-13)15(25)24-9-7-23(8-10-24)14-12(16(18,19)20)4-2-6-22-14/h1-6H,7-10H2/p+1